OTAVA-ZINC01971214 MOE2007 3D CORINA 3.40 0006 02.08.2006 48 51 0 0 1 0 0 0 0 0999 V2000 -0.0100 1.5440 -0.0070 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0030 0.0140 -0.0050 C 0 0 3 0 0 0 0 0 0 0 0 0 0.5270 -0.3440 0.8810 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7080 -0.4830 -1.2410 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0670 -0.7780 -2.2280 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0510 -0.6000 -1.2500 N 0 0 0 0 0 0 0 0 0 0 0 0 2.6990 -1.1510 -2.3630 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2010 -0.9270 -3.6390 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8420 -1.4700 -4.7360 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9800 -2.2370 -4.5660 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4820 -2.4640 -3.2980 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8480 -1.9190 -2.1940 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3440 -2.1370 -0.9470 O 0 0 0 0 0 0 0 0 0 0 0 0 5.5260 -2.9340 -0.8490 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6980 -0.6040 0.0090 S 0 0 0 0 0 0 0 0 0 0 0 0 -2.2240 -0.0170 1.5850 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5420 -0.2720 2.0480 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6320 -0.9920 1.4000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7500 -1.0440 2.1270 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5550 -0.2150 3.6620 S 0 0 0 0 0 0 0 0 0 0 0 0 -3.8920 0.2190 3.3030 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9850 0.9030 4.0140 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.7770 1.1140 3.5430 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3940 0.6650 2.3610 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.0280 -1.7340 1.6830 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9640 -1.9670 0.1720 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6290 -2.6340 -0.1720 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4990 -1.6220 0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0140 1.9160 -0.0160 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5340 1.9020 -0.8930 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5200 1.9040 0.8870 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5680 -0.3040 -0.4850 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3120 -0.3280 -3.7740 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4530 -1.2950 -5.7280 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4780 -2.6590 -5.4260 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3710 -3.0640 -3.1690 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3330 -2.4580 -1.4060 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8140 -3.0300 0.1980 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3330 -3.9230 -1.2640 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0730 1.6700 4.1440 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1240 -2.6910 2.1960 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8850 -1.1030 1.9190 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7860 -2.6160 -0.1330 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0400 -1.0120 -0.3480 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4680 -3.4880 0.4850 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6460 -2.9690 -1.2090 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5690 -0.8470 -0.7430 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5370 -2.1280 -0.0590 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 15 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 32 1 0 0 0 0 7 8 1 0 0 0 0 7 12 2 0 0 0 0 8 9 2 0 0 0 0 8 33 1 0 0 0 0 9 10 1 0 0 0 0 9 34 1 0 0 0 0 10 11 2 0 0 0 0 10 35 1 0 0 0 0 11 12 1 0 0 0 0 11 36 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 14 37 1 0 0 0 0 14 38 1 0 0 0 0 14 39 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 16 24 2 0 0 0 0 17 18 1 0 0 0 0 17 21 2 0 0 0 0 18 19 2 0 0 0 0 18 28 1 0 0 0 0 19 20 1 0 0 0 0 19 25 1 0 0 0 0 20 21 1 0 0 0 0 21 22 1 0 0 0 0 22 23 2 0 0 0 0 23 24 1 0 0 0 0 23 40 1 0 0 0 0 25 26 1 0 0 0 0 25 41 1 0 0 0 0 25 42 1 0 0 0 0 26 27 1 0 0 0 0 26 43 1 0 0 0 0 26 44 1 0 0 0 0 27 28 1 0 0 0 0 27 45 1 0 0 0 0 27 46 1 0 0 0 0 28 47 1 0 0 0 0 28 48 1 0 0 0 0 M END